N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[3-(4-methoxyphenyl)propanoyl]piperidin-3-yl}benzamide
Chemical Structure Depiction of
N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[3-(4-methoxyphenyl)propanoyl]piperidin-3-yl}benzamide
N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[3-(4-methoxyphenyl)propanoyl]piperidin-3-yl}benzamide
Compound characteristics
| Compound ID: | S617-0552 |
| Compound Name: | N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[3-(4-methoxyphenyl)propanoyl]piperidin-3-yl}benzamide |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C23 H28 N2 O4 |
| Smiles: | COc1ccc(CCC(N2CC[C@H](CO)[C@@H](C2)NC(c2ccccc2)=O)=O)cc1 |
| Stereo: | RELATIVE |
| logP: | 2.1777 |
| logD: | 2.1777 |
| logSw: | -2.328 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.288 |
| InChI Key: | QYDQOFNHYNFTQC-FPOVZHCZSA-N |